#!/bin/bash    
#PBS -l nodes=1:ppn=8                        
cd $PBS_O_WORKDIR         
PATH=/share/apps/intel/impi/3.2.0.011/bin64:/share/apps/intel/mkl/10.1.0.015/lib/64:$PATH
/share/apps/intel/impi/3.2.0.011/bin64/mpirun -np 8 ~/bin/cpmd.x 1.inp > 1.out
/share/apps/intel/impi/3.2.0.011/bin64/mpirun -np 8 ~/bin/cpmd.x 2.inp > 2.out
